N-(6-oxo-1H-pyridazin-3-yl)-3-(piperidine-1-carbonyl)benzamide

C17H18N4O3 — CID 146105541

IUPACN-(6-oxo-1H-pyridazin-3-yl)-3-(piperidine-1-carbonyl)benzamide
SMILESO=C(Nc1ccc(=O)[nH]n1)c1cccc(C(=O)N2CCCCC2)c1
InChIInChI=1S/C17H18N4O3/c22-15-8-7-14(19-20-15)18-16(23)12-5-4-6-13(11-12)17(24)21-9-2-1-3-10-21/h4-8,11H,1-3,9-10H2,(H,20,22)(H,18,19,23)
InChIKeyWMYHSHNIEMLZII-UHFFFAOYSA-N
MW326.36 g/mol
LogP1.65
Rot. Bonds3

About N-(6-oxo-1H-pyridazin-3-yl)-3-(piperidine-1-carbonyl)benzamide

N-(6-oxo-1H-pyridazin-3-yl)-3-(piperidine-1-carbonyl)benzamide (PubChem CID 146105541) has the molecular formula C17H18N4O3 and a molecular weight of 326.36 g/mol. Its IUPAC name is N-(6-oxo-1H-pyridazin-3-yl)-3-(piperidine-1-carbonyl)benzamide.

Molecular Properties

Compound NameN-(6-oxo-1H-pyridazin-3-yl)-3-(piperidine-1-carbonyl)benzamide
PubChem CID146105541
Molecular FormulaC17H18N4O3
Molecular Weight326.36 g/mol
Exact Mass326.14
IUPAC NameN-(6-oxo-1H-pyridazin-3-yl)-3-(piperidine-1-carbonyl)benzamide
SMILESO=C(Nc1ccc(=O)[nH]n1)c1cccc(C(=O)N2CCCCC2)c1
InChIInChI=1S/C17H18N4O3/c22-15-8-7-14(19-20-15)18-16(23)12-5-4-6-13(11-12)17(24)21-9-2-1-3-10-21/h4-8,11H,1-3,9-10H2,(H,20,22)(H,18,19,23)
InChIKeyWMYHSHNIEMLZII-UHFFFAOYSA-N
XLogP1.65
TPSA95.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.36
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(6-oxo-1H-pyridazin-3-yl)-3-(piperidine-1-carbonyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(6-oxo-1H-pyridazin-3-yl)piperidine-1-carboxamide
CID 108887313
4-[3-(2-cyclohexylethoxy)benzoyl]-N-(6-oxo-1H-pyridazin-3-yl)piperazine-1-carboxamide
CID 67313518
N-(3-acetylphenyl)-3-(azepane-1-carbonyl)benzamide
CID 109056722
N-cycloheptyl-3-(pyrrolidine-1-carbonyl)benzamide
CID 109051684
3-(azepane-1-carbonyl)-N-(2,4,6-trimethylphenyl)benzamide
CID 109056693
3-(azepane-1-carbonyl)-N-(3-fluorophenyl)benzamide
CID 109056732
3-(piperidine-1-carbonyl)-N-(4-pyrrolidin-1-ylphenyl)benzamide
CID 109052099
3-nitro-N-(6-oxo-1H-pyridazin-3-yl)-4-pyrrolidin-1-ylbenzamide
CID 122145941
N-tert-butyl-3-(piperidine-1-carbonyl)benzamide
CID 109052027
N-(3-fluorophenyl)-3-(pyrrolidine-1-carbonyl)benzamide
CID 109051768
6-bromo-N-(6-oxo-1H-pyridazin-3-yl)naphthalene-2-carboxamide
CID 116787217
3-(azepane-1-carbonyl)-N-[4-(dimethylamino)phenyl]benzamide
CID 109056729

Frequently Asked Questions

What is the IUPAC name of N-(6-oxo-1H-pyridazin-3-yl)-3-(piperidine-1-carbonyl)benzamide?
The IUPAC name of N-(6-oxo-1H-pyridazin-3-yl)-3-(piperidine-1-carbonyl)benzamide (CID 146105541) is N-(6-oxo-1H-pyridazin-3-yl)-3-(piperidine-1-carbonyl)benzamide.
What is the SMILES notation for N-(6-oxo-1H-pyridazin-3-yl)-3-(piperidine-1-carbonyl)benzamide?
The canonical SMILES for N-(6-oxo-1H-pyridazin-3-yl)-3-(piperidine-1-carbonyl)benzamide is O=C(Nc1ccc(=O)[nH]n1)c1cccc(C(=O)N2CCCCC2)c1.
What is the InChIKey of N-(6-oxo-1H-pyridazin-3-yl)-3-(piperidine-1-carbonyl)benzamide?
The InChIKey is WMYHSHNIEMLZII-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O3/c22-15-8-7-14(19-20-15)18-16(23)12-5-4-6-13(11-12)17(24)21-9-2-1-3-10-21/h4-8,11H,1-3,9-10H2,(H,20,22)(H,18,19,23).
What are the key properties of N-(6-oxo-1H-pyridazin-3-yl)-3-(piperidine-1-carbonyl)benzamide?
N-(6-oxo-1H-pyridazin-3-yl)-3-(piperidine-1-carbonyl)benzamide has a molecular weight of 326.36 g/mol, XLogP of 1.65, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-oxo-1H-pyridazin-3-yl)-3-(piperidine-1-carbonyl)benzamide is sourced from PubChem (CID 146105541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).